4-{5-[(1E)-2-cyano-3-(2,3-dichloroanilino)-3-oxo-1-propenyl]-2-furyl}benzoic acid

SpectraBase Compound ID	ENg8e47F2Sl
InChI	InChI=1S/C21H12Cl2N2O4/c22-16-2-1-3-17(19(16)23)25-20(26)14(11-24)10-15-8-9-18(29-15)12-4-6-13(7-5-12)21(27)28/h1-10H,(H,25,26)(H,27,28)/b14-10+
InChIKey	YGISQSLIIOFUKX-GXDHUFHOSA-N Google Search
Mol Weight	427.24 g/mol
Molecular Formula	C21H12Cl2N2O4
Exact Mass	426.017412 g/mol

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SpectraBase Spectrum ID	898EkdIL9ai
Name	4-{5-[(1E)-2-cyano-3-(2,3-dichloroanilino)-3-oxo-1-propenyl]-2-furyl}benzoic acid
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C21H12Cl2N2O4/c22-16-2-1-3-17(19(16)23)25-20(26)14(11-24)10-15-8-9-18(29-15)12-4-6-13(7-5-12)21(27)28/h1-10H,(H,25,26)(H,27,28)/b14-10+
InChIKey	YGISQSLIIOFUKX-GXDHUFHOSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_2760
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: UZI/1009863; Labnumber: ARF3576; UZI_ID: UZI-002762
Synonyms	4-{5-[2-cyano-3-(2,3-dichloroanilino)-3-oxo-1-propenyl]-2-furyl}benzoic acid
Temperature	315 °C